Geometry & MOs

Info

ID:	156684
PubChem CID:	56371685
Reduced:	O2S2N6C21H30 (1)
Stoich.:	A2B2C6D21E30 (1)
Weight, g/mol:	430.086639
ΔH_f, kcal/mol:	-13.8
Dipole, Da:	4.71
IP(EA), eV:	-9.29(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-(3-chloro-4-imidazol-1-ylphenyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC4=NN=C(N4C)C(C)C

DOS

IR

Vibrations